CHEBI:177815 - Flumezapine

ChEBI IDCHEBI:177815
ChEBI NameFlumezapine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H19FN4S
Net Charge0
Average Mass330.432
Monoisotopic Mass330.13145
SMILESCc1cc2c(s1)Nc1ccc(F)cc1N=C2N1CCN(C)CC1
InChIInChI=1S/C17H19FN4S/c1-11-9-13-16(22-7-5-21(2)6-8-22)19-15-10-12(18)3-4-14(15)20-17(13)23-11/h3-4,9-10,20H,5-8H2,1-2H3
InChIKeyJBHUBOISLBWHAR-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) sausage (ENVO:00002166) MetaboLights (MTBLS2871)
Roles Classification
Biological Role:
GABA modulator  A substance that does not act as agonist or antagonist but does affect the gamma-aminobutyric acid receptor-ionophore complex. GABA-A receptors appear to have at least three allosteric sites at which modulators act: a site at which benzodiazepines act by increasing the opening frequency of gamma-aminobutyric acid-activated chloride channels; a site at which barbiturates act to prolong the duration of channel opening; and a site at which some steroids may act.
Application:
GABA modulator  A substance that does not act as agonist or antagonist but does affect the gamma-aminobutyric acid receptor-ionophore complex. GABA-A receptors appear to have at least three allosteric sites at which modulators act: a site at which benzodiazepines act by increasing the opening frequency of gamma-aminobutyric acid-activated chloride channels; a site at which barbiturates act to prolong the duration of channel opening; and a site at which some steroids may act.
ChEBI Ontology
Outgoing Relation(s)
Flumezapine (CHEBI:177815) is a benzodiazepine (CHEBI:22720)
IUPAC Name 
7-luoro-2-methyl-4-(4-methylpiperazin-1-yl)-10H-thieno[2,3-b][1,5]benzodiazepine
Manual XrefsDatabases
10296395ChemSpider
D02659KEGG DRUG
Registry NumbersSources
CAS:61325-80-2ChemIDplus